STCO: Conditional Neural Operators for Time-Dependent PDEs

Neural operators have emerged as efficient surrogates for time-dependent physical systems governed by partial differential equations (PDEs), but their future-state predictions are often conditioned only on observed states and static problem descriptors. For control or optimization, however, body motion, inflow, or forcing are prescribed for the query without being determined solely by the observed state. We introduce the Spatiotemporal Conditional Operator (STCO) for prescribed-condition operator learning (PCOL), a common interface that supplies prescribed target-time condition fields to heterogeneous backbone architectures while retaining their architecture-specific core computation and context pathways. Its condition interface combines Flow-Aware Graph Leaf (FAGL) with Dual-Site Feature-wise Linear Modulation (DSFiLM). Non-learned FAGL uses vorticity from the final observed frame to construct a fixed-cardinality adaptive partition, then co-locates the observed history and target-time condition fields at its regional coordinates. DSFiLM injects separate motion, inflow, and force routes before and after operator computation through current-feature-driven slot- and channel-wise gates. We evaluate twelve matched backbone architectures with different existing physical and temporal inputs. The immersed-boundary computational fluid dynamics (CFD) benchmark spans prescribed motion, inflow disturbances, body-force actuation, and morphology. Across twelve matched backbones, three regimes, and two lead ranges, STCO yields mean paired reductions of 31.1% in relative-L2 field error and 24.7% in normalized pressure-derived load error. It also lowers longer-lead field error for 11 backbones, while interventions on individual condition groups produce measurable prediction changes for every group evaluated.

Learning Unsteady Aneurysm Hemodynamics with Physics-Informed DeepONets

Clinically actionable, patient-specific hemodynamic assessment, specifically wall shear stress, vortex structure and pressure distributions, is critical for determining risky or unfavorable evolution in Abdominal Aortic Aneurysms (AAA). While Physics-Informed Deep Operator Networks (PI-DeepONets) show promising results in complementing established 5 tools such as Computational Fluid Dynamics (CFD), a persistent architectural challenge remains for complex 3D flows. In this direction, we propose a Modified Multi-Input Multi-Output PI-DeepONets (M3PI-DeepONet) designed for predicting unsteady flows in an idealized AAA geometry. Central to our model is the Aggregated Injection strategy, where latent representations from multiple input branches are fused prior to trunk injection, allowing the coordinate basis to adapt to multiple physical constraints. To the best of our knowledge, this is the first architecture to combine the layer-wise gating mechanism with a multi-branch operator-network topology, yielding an input-adaptive trunk basis. Additionally, we integrate the 3D Navier-Stokes equations as governing physical laws, so the model is trained based on physics-informed residuals, initial and boundary conditions, and only 0.3% of the labeled internal data together with the selected branch-conditioning signals. The M3PI-DeepONet simultaneously predicts unsteady 3D flow velocity and pressure fields with an average relative L2 velocity error below 4% and pressure error around 5% while achieving a conservative retained-cycle inference speedup of approximately 36x compared to reference CFD simulations once the branch inputs used for conditioning are available. This work advances the application of deep learning in cardiovascular disease modeling, marking step toward real-time, non-invasive clinical diagnostics.

Variational Parameter Calibration with Physics-Aware Latent-Space Surrogates

Forward and inverse modeling of parametric dynamical systems requires surrogate models that are not only accurate for state prediction, but also informative for parameter calibration. However, a systematic end-to-end differentiable formulation for coupling deep-learning-based reduced-order surrogates with variational parameter estimation remains underdeveloped. In this work, we introduce a physics-aware neural-network-based latent-space framework for reduced-order forward modeling and variational parameter estimation. The proposed autoencoder-based approach yields a differentiable surrogate that maps physical parameters to predicted flow fields through a latent representation. The observable supervision is used during offline training to encourage the latent variables to retain information correlated with system parameters, while the online inverse problem is solved in the parameter space through the surrogate-induced observation operator. The method is evaluated on two computational-fluid-dynamics benchmarks. The results show that reconstruction accuracy alone is insufficient for inverse modeling, owing to the lack of end-to-end differentiability or physics awareness for variational parameter calibration. Quantitative latent-space analysis further shows that observable supervision improves case-level separability and temporal organization of latent representations. Experiments with realistic measurement settings, including noisy, low-resolution, randomly masked, and block-wise partial observations, demonstrate the robustness of the proposed framework and show that it generally reduces calibration error and variability compared with the standard surrogate models.

Inpainting U-Net for seamless pedestrian-level wind prediction across urban morphologies

Pedestrian-level wind prediction is essential for urban design and wind-comfort assessment, but high-fidelity simulations such as LES remain computationally expensive for rapid evaluation. This study develops a two-stage U-Net framework for efficient prediction of time-averaged pedestrian-level wind speed over realistic urban morphologies. The model is trained and evaluated using the UrbanTALES dataset, which contains realistic city configurations under different approaching wind directions. In the first stage, a baseline U-Net model (M1) predicts wind fields patch-by-patch from normalised building height and fetch information. This formulation allows application to urban domains of arbitrary size, but independent patch inference can introduce discontinuities at patch boundaries. To address this, a second U-Net model (M2) is introduced as an inpainting-based refinement model. M2 uses a larger contextual window containing the initial M1 prediction and local morphology to reduce discontinuities using neighbouring flow information. During full-field inference, M2 is applied iteratively using a Gauss-Seidel scheme until convergence. Results show that M1 captures the main spatial distribution of pedestrian-level wind speed and performs well in low- and moderate-velocity regions, although high-velocity peaks are less accurate. M2 substantially reduces patch-boundary artefacts and improves spatial coherence. Across unseen urban cases, the framework reproduces mean velocity and spatial variability reasonably well, while maximum velocities remain underestimated. Overall, the proposed framework provides an efficient and flexible surrogate model for high-resolution pedestrian-level wind prediction across realistic urban morphologies.

A Physics-Informed Fourier-Wavelet Transformer for Multiscale Computational Fluid Dynamics Surrogate Modeling

Physics-informed surrogate models can accelerate computational fluid dynamics simulations. However, many existing methods reproduce global flow patterns more reliably than localized multiscale structures. This study presents a physics-informed Fourier-wavelet transformer for next-step velocity-field reconstruction in real-world flow benchmarks. The proposed formulation combines hybrid Fourier-wavelet spectral encoding with physics-biased self-attention based on partial differential equation residual diagnostics. It also uses self-supervised pretraining through Masked Physics Prediction and Equation Consistency Prediction. The experiments are conducted on two real benchmark cases: cylinder-wake flow and fluid-structure interaction. All approaches are evaluated under a shared local protocol and compared with spectral, transformer-based, operator-learning, and physics-informed neural-network baselines. On the cylinder-wake benchmark, the proposed model achieves the best aggregate accuracy, with an all-channel normalized mean-squared error of 0.05875 and an all-channel Pearson correlation coefficient of 0.97019. On the fluid-structure-interaction benchmark, it gives the lowest all-channel normalized mean-squared error of $2.70 \times 10^{-4}$, compared with $4.02 \times 10^{-4}$ for the strongest baseline. Component-wise field comparisons and scale-separated diagnostics further show stronger recovery of localized wake structures, including near-body, wake-core, and far-wake features. The results demonstrate improved real-world flow reconstruction while maintaining a practical accuracy-cost tradeoff.

Prediction of Viscoelastic Droplet Impact Dynamics Using a Vision Transformer-Based Approach

Droplet impact on solid surfaces is a complex fluid dynamics problem with applications in spray cooling, inkjet printing, and pharmaceutical processing. Although numerical simulations are widely used to investigate these dynamics, their computational cost becomes significant when multiple parametric variations are considered. In this work, we investigate the use of a Video Vision Transformer (ViViT) architecture to predict the temporal evolution of viscoelastic droplets impacting solid surfaces using volume fraction fields obtained from the Volume of Fluid (VOF) method. In Newtonian fluids, impact dynamics are mainly characterized by the Reynolds number $Re$, representing the ratio of inertial to viscous forces, and the Weber number $We$, representing the ratio of inertial to surface tension forces. For viscoelastic fluids, additional parameters are required to account for elastic effects, namely the solvent viscosity ratio $β$ and the Weissenberg number $Wi$, increasing simulation complexity and cost. Instead of simulating the entire droplet dynamics, the proposed approach uses only the initial 10% to 20% of the simulation to predict the remaining evolution. Depending on the prediction configuration, this strategy reduces computational cost by approximately 80% to 90% compared to full numerical simulations. The ViViT produces physically consistent predictions across different parameters and prediction horizons, successfully capturing both spreading and bouncing regimes while preserving geometric features and structural similarity. Since volume fraction fields can also be extracted from experimental videos, the proposed framework could be extended to incorporate experimental data during training, potentially improving the physical fidelity of the predicted dynamics.

ShipNet: A Geometric Deep Learning Surrogate for Real-Time Ship Hydrodynamics

Accurate prediction of hydrodynamic performance is central to ship design, yet high-fidelity computational fluid dynamics remains prohibitively expensive for large-scale parametric exploration. This motivates the development of data-driven surrogate models that provide rapid approximations to hydrodynamic predictions at substantially reduced cost. We present ShipNet, a geometric deep-learning surrogate that predicts both hull-surface pressure distributions and far-field free-surface wave patterns directly from hull geometry and speed. The network employs a regularized dynamic graph convolutional backbone on hull point clouds, with a multi-head decoder for simultaneous near-body pressure and free-surface elevation outputs. Training data consist of 420 inviscid free-surface simulations generated using a potential-flow panel method for two parent yacht hulls, each parameterized into 70 variants and evaluated at three speeds. ShipNet predicts per-point pressure coefficient and two-dimensional wave elevation map using a composite loss that combines point-wise regression and image-structure terms. On a geometry-held-out test set, ShipNet achieves R^2=0.98 for hull pressure and R^2=0.91 for wave fields. Inference requires approximately 0.15s per case, yielding over a 550x speedup relative to the potential-flow solver on conventional hardware. Limitations include the restricted geometry and speed ranges and the inviscid training data, while future work will extend the model to high-fidelity viscous simulations with physics-informed regularization.

Drifting Models for Surrogate Flow Modeling

While Computational Fluid Dynamics (CFD) provides high-fidelity flow fields for optimizing indoor environments, its computational cost limits rapid exploration. To solve this problem generative surrogates offer better distribution modeling than deterministic networks, but iterative sampling is slow. To enable high-quality, single-pass generation, we adapt the novel generative drifting framework to fluid mechanics. We introduce a conditional architecture that performs drifting in a learned VAE latent space and uses label-aware masking to align generated samples with their boundary conditions. Our label-conditioned model matches iterative diffusion in accuracy and flow consistency while running two orders of magnitude faster. Additionally, we propose a spatial-conditioning variant that establishes a promising path towards generalization to unseen geometries. Ultimately, conditional drifting serves as a highly efficient alternative to diffusion based approaches, unlocking real-time CFD surrogates where inference speed is critical.